[(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate

C8H11FO4 — CID 89099524

IUPAC[(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate
SMILESCOC[C@H]1C=C(F)[C@@H](OC(C)=O)O1
InChIInChI=1S/C8H11FO4/c1-5(10)12-8-7(9)3-6(13-8)4-11-2/h3,6,8H,4H2,1-2H3/t6-,8+/m1/s1
InChIKeyBYBPXQPVUZTJQS-SVRRBLITSA-N
MW190.17 g/mol
LogP0.77
Rot. Bonds3

About [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate

[(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate (PubChem CID 89099524) has the molecular formula C8H11FO4 and a molecular weight of 190.17 g/mol. Its IUPAC name is [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate.

Molecular Properties

Compound Name[(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate
PubChem CID89099524
Molecular FormulaC8H11FO4
Molecular Weight190.17 g/mol
Exact Mass190.06
IUPAC Name[(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate
SMILESCOC[C@H]1C=C(F)[C@@H](OC(C)=O)O1
InChIInChI=1S/C8H11FO4/c1-5(10)12-8-7(9)3-6(13-8)4-11-2/h3,6,8H,4H2,1-2H3/t6-,8+/m1/s1
InChIKeyBYBPXQPVUZTJQS-SVRRBLITSA-N
XLogP0.77
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.17
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate?
The IUPAC name of [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate (CID 89099524) is [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate.
What is the SMILES notation for [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate?
The canonical SMILES for [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate is COC[C@H]1C=C(F)[C@@H](OC(C)=O)O1.
What is the InChIKey of [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate?
The InChIKey is BYBPXQPVUZTJQS-SVRRBLITSA-N. The full InChI is InChI=1S/C8H11FO4/c1-5(10)12-8-7(9)3-6(13-8)4-11-2/h3,6,8H,4H2,1-2H3/t6-,8+/m1/s1.
What are the key properties of [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate?
[(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate has a molecular weight of 190.17 g/mol, XLogP of 0.77, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,5R)-3-fluoro-5-(methoxymethyl)-2,5-dihydrofuran-2-yl] acetate is sourced from PubChem (CID 89099524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).